40
2etbu_cistrans170.xyz
Zr      -0.0202   0.0023   0.0071
C        2.2372   0.0251  -0.0544
C        2.0929   1.5047  -0.0472
C        2.6155   2.1376  -1.3298
C        2.7340   3.6357  -1.3379
H        2.0148   1.7856  -2.1868
H        3.6254   1.7038  -1.4714
H        3.1719   3.9770  -2.2905
H        3.3910   4.0001  -0.5309
H        1.7543   4.1355  -1.2302
C        2.6485   2.1591   1.2089
C        1.8603   3.3281   1.7310
H        2.7171  -0.3688  -0.9605
H        2.7220  -0.3643   0.8520
H        0.9623   1.8491  -0.0261
H        2.7428   1.3900   1.9956
H        3.6891   2.4613   0.9763
H        2.3402   3.7698   2.6205
H        1.7505   4.1284   0.9814
H        0.8419   3.0106   2.0302
C       -1.0517   0.5027   2.2146
C       -1.7411  -0.5808   1.6506
C       -0.8452  -1.6709   1.5760
C        0.3940  -1.2550   2.1014
C        0.2670   0.0918   2.4836
H       -1.4715   1.4905   2.4236
H       -2.7935  -0.5946   1.3647
H       -1.0927  -2.6780   1.2331
H        1.2852  -1.8752   2.2140
H        1.0444   0.7073   2.9420
C       -0.4584   0.7056  -2.3085
C       -1.6864   0.2578  -1.7771
C       -1.5786  -1.1217  -1.5433
C       -0.2823  -1.5283  -1.9156
C        0.4061  -0.4023  -2.4012
H       -0.2387   1.7246  -2.6422
H       -2.5767   0.8682  -1.6107
H       -2.3680  -1.7689  -1.1610
H        0.1103  -2.5473  -1.8660
H        1.4162  -0.3978  -2.8134
